General Information of the Compound
| Compound ID |
CP0511587
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| Compound Name |
1-(4-chloro-5-(4-(trifluoromethyl)phenyl)-1H-imidazol-2-yl)-4-(3-(trifluoromethyl)pyridin-2-yl)piperazine
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| Structure |
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| Formula |
C20H16ClF6N5
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| Molecular Weight |
475.824
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| Canonical SMILES |
FC(F)(F)c1ccc(cc1)-c1nc([nH]c1Cl)N1CCN(CC1)c1ncccc1C(F)(F)F
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| InChI |
InChI=1S/C20H16ClF6N5/c21-16-15(12-3-5-13(6-4-12)19(22,23)24)29-18(30-16)32-10-8-31(9-11-32)17-14(20(25,26)27)2-1-7-28-17/h1-7H,8-11H2,(H,29,30)
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| InChIKey |
BTYALXYBVLKQFV-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound